N-(9-methylcarbazol-3-yl)-3-pyridin-4-ylpropanamide

C21H19N3O — CID 10892838

IUPACN-(9-methylcarbazol-3-yl)-3-pyridin-4-ylpropanamide
SMILESCn1c2ccccc2c2cc(NC(=O)CCc3ccncc3)ccc21
InChIInChI=1S/C21H19N3O/c1-24-19-5-3-2-4-17(19)18-14-16(7-8-20(18)24)23-21(25)9-6-15-10-12-22-13-11-15/h2-5,7-8,10-14H,6,9H2,1H3,(H,23,25)
InChIKeyJPDVZFGZORGXAL-UHFFFAOYSA-N
MW329.40 g/mol
LogP4.30
Rot. Bonds4

About N-(9-methylcarbazol-3-yl)-3-pyridin-4-ylpropanamide

N-(9-methylcarbazol-3-yl)-3-pyridin-4-ylpropanamide (PubChem CID 10892838) has the molecular formula C21H19N3O and a molecular weight of 329.40 g/mol. Its IUPAC name is N-(9-methylcarbazol-3-yl)-3-pyridin-4-ylpropanamide.

Molecular Properties

Compound NameN-(9-methylcarbazol-3-yl)-3-pyridin-4-ylpropanamide
PubChem CID10892838
Molecular FormulaC21H19N3O
Molecular Weight329.40 g/mol
Exact Mass329.15
IUPAC NameN-(9-methylcarbazol-3-yl)-3-pyridin-4-ylpropanamide
SMILESCn1c2ccccc2c2cc(NC(=O)CCc3ccncc3)ccc21
InChIInChI=1S/C21H19N3O/c1-24-19-5-3-2-4-17(19)18-14-16(7-8-20(18)24)23-21(25)9-6-15-10-12-22-13-11-15/h2-5,7-8,10-14H,6,9H2,1H3,(H,23,25)
InChIKeyJPDVZFGZORGXAL-UHFFFAOYSA-N
XLogP4.30
TPSA46.92 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500329.40
LogP ≤ 54.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(9-methylcarbazol-3-yl)-3-pyridin-4-ylpropanamide?
The IUPAC name of N-(9-methylcarbazol-3-yl)-3-pyridin-4-ylpropanamide (CID 10892838) is N-(9-methylcarbazol-3-yl)-3-pyridin-4-ylpropanamide.
What is the SMILES notation for N-(9-methylcarbazol-3-yl)-3-pyridin-4-ylpropanamide?
The canonical SMILES for N-(9-methylcarbazol-3-yl)-3-pyridin-4-ylpropanamide is Cn1c2ccccc2c2cc(NC(=O)CCc3ccncc3)ccc21.
What is the InChIKey of N-(9-methylcarbazol-3-yl)-3-pyridin-4-ylpropanamide?
The InChIKey is JPDVZFGZORGXAL-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H19N3O/c1-24-19-5-3-2-4-17(19)18-14-16(7-8-20(18)24)23-21(25)9-6-15-10-12-22-13-11-15/h2-5,7-8,10-14H,6,9H2,1H3,(H,23,25).
What are the key properties of N-(9-methylcarbazol-3-yl)-3-pyridin-4-ylpropanamide?
N-(9-methylcarbazol-3-yl)-3-pyridin-4-ylpropanamide has a molecular weight of 329.40 g/mol, XLogP of 4.30, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(9-methylcarbazol-3-yl)-3-pyridin-4-ylpropanamide is sourced from PubChem (CID 10892838), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).